CID 13280

Brn 2700528

Structural Information

Molecular Formula
C10H13ClN2O3S
SMILES
CCN(C1=CC=C(C=C1)S(=O)(=O)N)C(=O)CCl
InChI
InChI=1S/C10H13ClN2O3S/c1-2-13(10(14)7-11)8-3-5-9(6-4-8)17(12,15)16/h3-6H,2,7H2,1H3,(H2,12,15,16)
InChIKey
PLUDDCOOIORTFB-UHFFFAOYSA-N
Compound name
2-chloro-N-ethyl-N-(4-sulfamoylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.03354 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.040816 157.6
[M+Na]+ 299.022758 165.1
[M-H]- 275.026264 162.4
[M+NH4]+ 294.067363 174.8
[M+K]+ 314.996698 161.6
[M+H-H2O]+ 259.030800 152.0
[M+HCOO]- 321.031741 172.4
[M+CH3COO]- 335.047391 199.8
[M+Na-2H]- 297.008206 159.9
[M]+ 276.03299142 162.0
[M]- 276.03408858 162.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.